5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide

C17H19N3O — CID 109223789

IUPAC5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESO=C(NCCc1ccccc1)c1cncc(NC2CC2)c1
InChIInChI=1S/C17H19N3O/c21-17(19-9-8-13-4-2-1-3-5-13)14-10-16(12-18-11-14)20-15-6-7-15/h1-5,10-12,15,20H,6-9H2,(H,19,21)
InChIKeyNUFUHNFKSGLUMS-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.63
Rot. Bonds6

About 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide

5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide (PubChem CID 109223789) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide
PubChem CID109223789
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESO=C(NCCc1ccccc1)c1cncc(NC2CC2)c1
InChIInChI=1S/C17H19N3O/c21-17(19-9-8-13-4-2-1-3-5-13)14-10-16(12-18-11-14)20-15-6-7-15/h1-5,10-12,15,20H,6-9H2,(H,19,21)
InChIKeyNUFUHNFKSGLUMS-UHFFFAOYSA-N
XLogP2.63
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cyclopropylamino)-N-propylpyridine-3-carboxamide
CID 109222760
5-(cyclohexylamino)-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109226851
5-(4-bromoanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235844
5-[(1,1-dioxothiolan-3-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109236844
5-(2,4-difluoroanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235876
N-(2-phenylethyl)-5-[2-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109235856
5-(cyclopropylamino)-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109223782
3-N-(2-phenylethyl)-5-N-prop-2-enylpyridine-3,5-dicarboxamide
CID 109101755
5-N-[2-(dimethylamino)ethyl]-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109104046
3-N-(2-phenylethyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101366
5-(cyclopentylamino)-N-cyclopropylpyridine-3-carboxamide
CID 109223558
5-(cyclopentylamino)-N-pentylpyridine-3-carboxamide
CID 109226139

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide?
The IUPAC name of 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide (CID 109223789) is 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide is O=C(NCCc1ccccc1)c1cncc(NC2CC2)c1.
What is the InChIKey of 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide?
The InChIKey is NUFUHNFKSGLUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c21-17(19-9-8-13-4-2-1-3-5-13)14-10-16(12-18-11-14)20-15-6-7-15/h1-5,10-12,15,20H,6-9H2,(H,19,21).
What are the key properties of 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide?
5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylamino)-N-(2-phenylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 109223789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).